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Search term: HJVJZEYDDUPXRP-FSJBWODESA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 2-[(E)-{[2-(2-Chlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]-6-methoxyphenol | C21H15ClN2O3

2-[(E)-{[2-(2-Chlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]-6-methoxyphenol

  • Molecular FormulaC21H15ClN2O3
  • Average mass378.808 Da
  • Monoisotopic mass378.077118 Da
  • ChemSpider ID21539694
  • Double-bond stereo - Double-bond stereo


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-[(E)-{[2-(2-Chlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]-6-methoxyphenol [ACD/IUPAC Name]
2-[(E)-{[2-(2-Chlorophényl)-1,3-benzoxazol-5-yl]imino}méthyl]-6-méthoxyphénol [French] [ACD/IUPAC Name]
2-[(E)-{[2-(2-Chlorphenyl)-1,3-benzoxazol-5-yl]imino}methyl]-6-methoxyphenol [German] [ACD/IUPAC Name]
Phenol, 2-[(E)-[[2-(2-chlorophenyl)-5-benzoxazolyl]imino]methyl]-6-methoxy- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 542.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.2±3.0 kJ/mol
Flash Point: 282.0±30.1 °C
Index of Refraction: 1.646
Molar Refractivity: 103.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 4.48
ACD/BCF (pH 5.5): 1327.09
ACD/KOC (pH 5.5): 5167.41
ACD/LogD (pH 7.4): 4.62
ACD/BCF (pH 7.4): 1829.77
ACD/KOC (pH 7.4): 7124.75
Polar Surface Area: 68 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 48.4±7.0 dyne/cm
Molar Volume: 284.6±7.0 cm3

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